Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2855263

CCS(=O)(=O)c1ccc(NC(C)=O)cc1CNC.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
DDR1 Q08345 12/20 0.41
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CDK1 P06493 1/20 0.40
HPGD P15428 1/20 0.39
KDM4E B2RXH2 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8244193 0.91 ALDH1A1 (0.49) ALDH1A1DDR1SMN1; SMN2CDK1HPGD
SCHEMBL14035784 0.84 L3MBTL1 (0.47) ALDH1A1DDR1L3MBTL1
SCHEMBL2855266 0.80 DDR1 (0.39) ALDH1A1DDR1SMN1; SMN2HPGD
SCHEMBL5038734 0.79 ALDH1A1 (0.40) ALDH1A1DDR1MAPK1SMN1; SMN2L3MBTL1
SCHEMBL14035945 0.79 ALDH1A1 (0.42) ALDH1A1MAPK1SMN1; SMN2L3MBTL1CDK1
Trifluoroacetic Acid SCHEMBL4613399 0.78 DDR1 (0.40) DDR1
SCHEMBL2535835 0.77 ALDH1A1 (0.50) ALDH1A1MAPK1SMN1; SMN2CDK1HPGD
SCHEMBL2873949 0.73 MAPK1 (0.42) ALDH1A1MAPK1SMN1; SMN2L3MBTL1CDK1
SCHEMBL5038736 0.71 L3MBTL1 (0.43) ALDH1A1MAPK1SMN1; SMN2L3MBTL1CDK1
SCHEMBL2542795 0.70 ALDH1A1 (0.56) ALDH1A1CDK1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910298-B1 PHENYLGLYCINAMIDE AND PYRIDYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS BRISTOL MYERS SQUIBB CO (US) 2010-01-13 EP disclosed
US-7456195-B2 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-25 US disclosed
US-20070003539-A1 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070003539-A1 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants F12, F11, F7 ALDH1A1 2963/4885DDR1 2051/4885MAPK1 1612/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.